>compound Rhamnetin_Rhamnetin
#instrument UPLC Q-Tof Premier, Waters
>formula C16H12O7
#smiles COc(c3)cc(O1)c(c(O)3)C(=O)C(O)=C1c(c2)cc(O)c(O)c2
#RECORD LC-ESI-QTOF_train_data/PR100234.txt;LC-ESI-QTOF_train_data/PR100647.txt
>charge 1
>ionization [M+H]+
>parentmass 317.0661

>collision 5-60
123.0441 11.84
137.0237 9.361
167.0326 9.742
179.0326 5.526
200.0447 4.871
207.0297 7.569
208.0346 7.593
209.0301 13.57
224.0638 4.6
225.0621 6.165
243.0635 6.003
274.0461 9.182
283.0449 4.662
302.0388 5.713
317.0661 88.39

>collision 5-60
97.0305 10.21
121.0295 18.83
151.0019 7.68
164.8938 11.01
165.0185 54.11
193.0141 6.979
281.8761 7.256
300.0289 18.05
314.915 9.269
315.0505 77.41

